Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2169716 | 0.83 | CCR1 (0.47) | POLBTSHRCCR1KCNH2SMN1; SMN2 | |
| SCHEMBL9954937 | 0.79 | NR3C2 (0.38) | CCR1KCNH2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21591538 | 0.77 | GSK3A (0.50) | POLBKDM4E | |
| Hydrochloric Acid SCHEMBL2170595 | 0.76 | HRH1 (0.39) | CCR1KCNH2CYP2D6CYP2C19 | |
| SCHEMBL3126594 | 0.74 | ALDH1A1 (0.41) | CCR1KCNH2 | |
| SCHEMBL25374953 | 0.74 | KDM4E (0.38) | POLBKDM4ETSHREPHX2HPGD | |
| SCHEMBL2844665 | 0.73 | KDM4E (0.54) | POLBKDM4EEPHX2SMN1; SMN2HPGD | |
| SCHEMBL1870856 | 0.72 | CCR1 (0.40) | POLBTSHRCCR1KCNH2 | |
| Hydrochloric Acid SCHEMBL2170122 | 0.72 | LOXL2 (0.41) | KDM4ETSHRSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL2644511 | 0.71 | CCR1 (0.36) | KDM4ECCR1KCNH2SMN1; SMN2HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346868-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010036632-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-01 | — | — | WO | disclosed |